Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Dibromobuphenine HCl
RN: 22103-12-4
InChIKey: HCRXUHKRLGACNP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H23-Br2-N-O2.Cl-H

Molecular Weight

  • 493.665
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Results Name

  • Dibromobuphenine HCl

Synonyms

  • 1-(3,5-Dibromo-4-hydroxyphenyl)-2-(1-methyl-3-phenylpropylamino)propanol hydrochloride
  • Dibromobuphenine hydrochloride

Systematic Name

  • Benzyl alcohol, 3,5-dibromo-4-hydroxy-alpha-(1-((1-methyl-3-phenylpropyl)amino)ethyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 22103-12-4

System Generated Number

  • 0022103124

Molecular Formulas

Molecular Formula

  • C19-H23-Br2-N-O2.Cl-H

Molecular Formula Fragments

  • C19-H23-Br2-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C19H23Br2NO2.ClH/c1-12(8-9-14-6-4-3-5-7-14)22-13(2)18(23)15-10-16(20)19(24)17(21)11-15;/h3-7,10-13,18,22-24H,8-9H2,1-2H3;1H

InChIKey

HCRXUHKRLGACNP-UHFFFAOYSA-N

Smiles

c1([C@@H]([C@@H](C)N[C@@H](CCc2ccccc2)C)O)cc(c(c(c1)Br)O)Br.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 24mg/kg (24mg/kg)   United States Patent Document. Vol. #3542870,
mouse LD50 oral > 600mg/kg (600mg/kg)   United States Patent Document. Vol. #3542870,
rat LD50 intravenous 67700ug/kg (67.7mg/kg)   United States Patent Document. Vol. #3542870,